3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[2-(4-methylpiperidin-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Chemical Structure Depiction of
3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[2-(4-methylpiperidin-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[2-(4-methylpiperidin-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide
Compound characteristics
Compound ID: | M027-0558 |
Compound Name: | 3-[2-(4-methylbenzene-1-sulfonyl)ethyl]-N-[2-(4-methylpiperidin-1-yl)ethyl]-1,2,4-oxadiazole-5-carboxamide |
Molecular Weight: | 420.53 |
Molecular Formula: | C20 H28 N4 O4 S |
Smiles: | CC1CCN(CC1)CCNC(c1nc(CCS(c2ccc(C)cc2)(=O)=O)no1)=O |
Stereo: | ACHIRAL |
logP: | 2.09 |
logD: | 0.5996 |
logSw: | -2.8207 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 90.18 |
InChI Key: | WAFLFXIASHCYMV-UHFFFAOYSA-N |